ChemSpider 2D Image | 6-(4-{[1-(2-Chlorophenyl)-1H-1,2,3-triazol-4-yl]methyl}-1-piperazinyl)phenanthridine | C26H23ClN6

6-(4-{[1-(2-Chlorophenyl)-1H-1,2,3-triazol-4-yl]methyl}-1-piperazinyl)phenanthridine

  • Molecular FormulaC26H23ClN6
  • Average mass454.954 Da
  • Monoisotopic mass454.167267 Da
  • ChemSpider ID31132615

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

6-(4-{[1-(2-Chlorophenyl)-1H-1,2,3-triazol-4-yl]methyl}-1-piperazinyl)phenanthridine [ACD/IUPAC Name]
6-(4-{[1-(2-Chlorophényl)-1H-1,2,3-triazol-4-yl]méthyl}-1-pipérazinyl)phénanthridine [French] [ACD/IUPAC Name]
6-(4-{[1-(2-Chlorphenyl)-1H-1,2,3-triazol-4-yl]methyl}-1-piperazinyl)phenanthridin [German] [ACD/IUPAC Name]
Phenanthridine, 6-[4-[[1-(2-chlorophenyl)-1H-1,2,3-triazol-4-yl]methyl]-1-piperazinyl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 681.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.9±3.0 kJ/mol
Flash Point: 365.7±34.3 °C
Index of Refraction: 1.722
Molar Refractivity: 132.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.19
ACD/LogD (pH 5.5): 2.70
ACD/BCF (pH 5.5): 19.44
ACD/KOC (pH 5.5): 67.97
ACD/LogD (pH 7.4): 4.21
ACD/BCF (pH 7.4): 624.94
ACD/KOC (pH 7.4): 2185.10
Polar Surface Area: 50 Å2
Polarizability: 52.6±0.5 10-24cm3
Surface Tension: 56.6±7.0 dyne/cm
Molar Volume: 335.5±7.0 cm3

Click to predict properties on the Chemicalize site


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